3-bromanyl-5-nitro-2-[(2,4,5-trimethylphenyl)diazenyl]benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-nitro-2-[(2,4,5-trimethylphenyl)diazenyl]benzenecarbonitrile Openeye Name: 3-bromo-5-nitro-2-(2,4,5-trimethylphenyl)azo-benzonitrile CAS Name: 3-bromo-5-nitro-2-(2,4,5-trimethylphenyl)azobenzonitrile IUPAC Name: 3-bromo-5-nitro-2-[(2,4,5-trimethylphenyl)diazenyl]benzonitrile Traditional Name: 3-bromo-5-nitro-2-(2,4,5-trimethylphenyl)azo-benzonitrile Formula: C16H13BrN4O2 MolecularWeight: 373.20402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=C(C=C1C)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])Br)C

InChI

InChI=1S/C16H13BrN4O2/c1-9-4-11(3)15(5-10(9)2)19-20-16-12(8-18)6-13(21(22)23)7-14(16)17/h4-7H,1-3H3